N-[2-[[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[[5-(cyclopropylcarbonylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[5-(cyclopropanecarbonylamino)-2-methyl-anilino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[5-[[cyclopropyl(oxo)methyl]amino]-2-methylanilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[5-(cyclopropanecarbonylamino)-2-methylanilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[5-(cyclopropanecarbonylamino)-2-methyl-anilino]-2-keto-ethyl]-piperonylamide Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H21N3O5/c1-12-2-6-15(23-21(27)13-3-4-13)9-16(12)24-19(25)10-22-20(26)14-5-7-17-18(8-14)29-11-28-17/h2,5-9,13H,3-4,10-11H2,1H3,(H,22,26)(H,23,27)(H,24,25)